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Physical Chemistry Chemical Physics : PCCP
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July 19, 2018
Probing the π → π* photoisomerization mechanism of trans-azobenzene by multi-state ab initio on-the-fly trajectory dynamics simulations
Chao Xu, Le Yu, Feng Long Gu, et al.
RSC Advances
|
May 6, 2022
A nonlinear optical switch induced by an external electric field: inorganic alkaline-earth alkalide
Bo Li, Daoling Peng, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
November 20, 2025
Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals
Feng Long Gu, Daoling Peng, Liang Peng, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 15, 2015
Theoretical study on catalyzed selective photoreduction mechanism for 4-bromobenzaldehyde in two different solvents
Xiao Huang, Liang Peng, Feng Long Gu, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 15, 2021
Photoisomerization-mechanism-associated excited-state hydrogen transfer in 2'-hydroxychalcone revealed by on-the-fly trajectory surface-hopping molecular dynamics simulation
Ying Hu, Ling Yue, Feng Long Gu, et al.
Journal of Computational Chemistry
|
November 20, 2019
Functional and Basis Set Dependence for Time-Dependent Density Functional Theory Trajectory Surface Hopping Molecular Dynamics: Cis-Azobenzene Photoisomerization
Linfeng Ye, Chao Xu, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
January 19, 2026
Correction to "Regularized Localized Molecular Orbitals in a Divide-and-Conquer Approach for Linear Scaling Calculations"
Liang Peng, Daoling Peng, Feng Long Gu, et al.
Behavioural Brain Research
|
March 27, 2007
Involvement of galanin in nociceptive regulation in the arcuate nucleus of hypothalamus in rats with mononeuropathy
Xing-Long Gu, Yan-Gang Sun, Long-Chuan Yu
Journal of Chemical Theory and Computation
|
April 13, 2022
Regularized Localized Molecular Orbitals in a Divide-and-Conquer Approach for Linear Scaling Calculations
Liang Peng, Daoling Peng, Feng Long Gu, et al.
The Journal of Physical Chemistry Letters
|
October 14, 2021
Simulation of Open Quantum Dynamics with Bootstrap-Based Long Short-Term Memory Recurrent Neural Network
Kunni Lin, Jiawei Peng, Feng Long Gu, et al.
Page
of 38
Search research articles
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Showing results (31-40 of 375) with videos related to
Sort By:
Page
of 38
Physical Chemistry Chemical Physics : PCCP
|
July 19, 2018
Probing the π → π* photoisomerization mechanism of trans-azobenzene by multi-state ab initio on-the-fly trajectory dynamics simulations
Chao Xu, Le Yu, Feng Long Gu, et al.
RSC Advances
|
May 6, 2022
A nonlinear optical switch induced by an external electric field: inorganic alkaline-earth alkalide
Bo Li, Daoling Peng, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
November 20, 2025
Electronic Excitation Energy Calculations with Configuration Interaction Based on Nonorthogonal Localized Molecular Orbitals
Feng Long Gu, Daoling Peng, Liang Peng, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 15, 2015
Theoretical study on catalyzed selective photoreduction mechanism for 4-bromobenzaldehyde in two different solvents
Xiao Huang, Liang Peng, Feng Long Gu, et al.
Physical Chemistry Chemical Physics : PCCP
|
February 15, 2021
Photoisomerization-mechanism-associated excited-state hydrogen transfer in 2'-hydroxychalcone revealed by on-the-fly trajectory surface-hopping molecular dynamics simulation
Ying Hu, Ling Yue, Feng Long Gu, et al.
Journal of Computational Chemistry
|
November 20, 2019
Functional and Basis Set Dependence for Time-Dependent Density Functional Theory Trajectory Surface Hopping Molecular Dynamics: Cis-Azobenzene Photoisomerization
Linfeng Ye, Chao Xu, Feng Long Gu, et al.
Journal of Chemical Theory and Computation
|
January 19, 2026
Correction to "Regularized Localized Molecular Orbitals in a Divide-and-Conquer Approach for Linear Scaling Calculations"
Liang Peng, Daoling Peng, Feng Long Gu, et al.
Behavioural Brain Research
|
March 27, 2007
Involvement of galanin in nociceptive regulation in the arcuate nucleus of hypothalamus in rats with mononeuropathy
Xing-Long Gu, Yan-Gang Sun, Long-Chuan Yu
Journal of Chemical Theory and Computation
|
April 13, 2022
Regularized Localized Molecular Orbitals in a Divide-and-Conquer Approach for Linear Scaling Calculations
Liang Peng, Daoling Peng, Feng Long Gu, et al.
The Journal of Physical Chemistry Letters
|
October 14, 2021
Simulation of Open Quantum Dynamics with Bootstrap-Based Long Short-Term Memory Recurrent Neural Network
Kunni Lin, Jiawei Peng, Feng Long Gu, et al.
Page
of 38